Geometry & MOs

Info

ID:	317442
PubChem CID:	126637676
Reduced:	N2O3C19H24 (1)
Stoich.:	A2B3C19D24 (1)
Weight, g/mol:	265.061804
ΔH_f, kcal/mol:	-94.15
Dipole, Da:	2.24
IP(EA), eV:	-9.09(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-(4-chloropyrrolo[2,3-d]pyrimidin-7-yl)oxolan-2-yl]acetaldehyde

Drug info:

PubChemData

Smile

CCC1=C(C(OC2=C1C=CN=C2)C3CCOCC3)/C=C(\C)/C(=O)N

DOS

IR

Vibrations